3-nitro-1H-1,2,4-triazole-5-carboxylic acid

Systemtic Name: 3-nitro-1H-1,2,4-triazole-5-carboxylic acid Openeye Name: 3-nitro-1H-1,2,4-triazole-5-carboxylic acid CAS Name: 3-nitro-1H-1,2,4-triazole-5-carboxylic acid IUPAC Name: 3-nitro-1H-1,2,4-triazole-5-carboxylic acid Traditional Name: 3-nitro-1H-1,2,4-triazole-5-carboxylic acid Formula: C3H2N4O4 MolecularWeight: 158.07238

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Descriptors Computed from Structure

Canonical SMILES:

C1(=NC(=NN1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1(=NC(=NN1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C3H2N4O4/c8-2(9)1-4-3(6-5-1)7(10)11/h(H,8,9)(H,4,5,6)